%chk=000153386.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153386

0 1
 O   -2.747800      0.1674000     -8.2699999E-02
 O  -0.3720000      0.5921000      -1.659100    
 O    3.743900       2.809600     -0.2304000    
 O    5.450300      0.7668000      0.5747000    
 N  -0.7763000      -1.145000     -0.2156000    
 N    2.017100      -2.479000      9.6500002E-02
 C  -0.3667000      -2.319100      0.5489000    
 C   -1.640500      -3.171800      0.6370000    
 C   -2.226900      -1.115200     -0.3933000    
 C   -2.753800      -2.142600      0.5990000    
 C   0.7348000      -3.075400     -0.1710000    
 C   4.9899999E-02 -0.2128000     -0.8245000    
 C    1.485800     -9.9600002E-02 -0.4240000    
 C    2.341300      -1.141900     -2.2800000E-02
 C   -4.167800      0.1821000     -0.1403000    
 C    1.987400       1.222400     -0.4840000    
 C   -4.658500       1.586400      0.1821000    
 C    3.676300     -0.8002000      0.3067000    
 C    3.307100       1.522800     -0.1546000    
 C    4.156600      0.5067000      0.2423000    
 C   -6.181900       1.671400      0.1538000    
 C   -6.669200       3.064500      0.5185000    
 C    3.611100       3.610500      0.9429000    
 H  -6.4599998E-02  -1.980700       1.548000    
 H   -1.664500      -3.788900       1.540000    
 H   -1.731900      -3.838200     -0.2303000    
 H   -2.445600      -1.380400      -1.435100    
 H   -3.706300      -2.584500      0.2906000    
 H   -2.888100      -1.707100       1.597500    
 H   0.7708000      -4.110700      0.1881000    
 H   0.5608000      -3.118800      -1.253300    
 H    2.761100      -3.113900      0.3679000    
 H   -4.603600     -0.5050000      0.5916000    
 H   -4.498100     -0.1105000      -1.144000    
 H    1.340900       2.046800     -0.7825000    
 H   -4.224600       2.297300     -0.5322000    
 H   -4.280200       1.884000       1.168200    
 H    4.364300      -1.584300      0.6250000    
 H   -6.609600      0.9479000      0.8578000    
 H   -6.550900       1.409500     -0.8447000    
 H   -6.345400       3.342200       1.526600    
 H   -6.284600       3.810800     -0.1841000    
 H   -7.762600       3.103100      0.4903000    
 H    5.621000       1.714400      0.4367000    
 H    4.155600       3.165000       1.781400    
 H    2.555100       3.732300       1.203700    
 H    4.035800       4.596300      0.7343000    


%chk=000153386-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000153386

0 1
O -3.169087 -0.710565 0.476504
O -0.854359 0.419847 -1.162827
O 3.298592 2.983113 -0.118516
O 5.007654 1.308871 1.083673
N -0.943934 -1.598361 -0.079993
N 2.003375 -2.439880 0.731447
C -0.460373 -2.845249 0.560561
C -1.512375 -3.887563 0.104554
C -2.412360 -1.641602 -0.357919
C -2.823177 -3.079432 0.039410
C 0.958750 -3.233978 0.105079
C -0.226453 -0.473409 -0.484397
C 1.206147 -0.207684 -0.092544
C 2.183450 -1.072096 0.511188
C -3.785813 0.432503 -0.239497
C 1.585390 1.155352 -0.331557
C -4.342117 1.382467 0.824790
C 3.449854 -0.535814 0.903321
C 2.824463 1.659526 0.045738
C 3.768380 0.804316 0.690827
C -5.064172 2.599011 0.199875
C -5.630243 3.562778 1.265272
C 2.389155 3.936322 -0.755232
H -0.461766 -2.744702 1.665013
H -1.568750 -4.744602 0.797719
H -1.234599 -4.270748 -0.896864
H -2.576649 -1.396649 -1.424879
H -3.564612 -3.498938 -0.660145
H -3.292075 -3.015331 1.037106
H 1.128175 -4.291566 0.376727
H 0.998215 -3.159502 -1.004246
H 2.774886 -2.934271 1.175923
H -4.608381 0.056415 -0.887911
H -3.018498 0.922415 -0.866234
H 0.825935 1.774720 -0.817361
H -3.507102 1.726650 1.465167
H -5.041947 0.826392 1.479651
H 4.204582 -1.182867 1.363414
H -5.888324 2.243765 -0.452585
H -4.359032 3.146086 -0.458279
H -6.359360 3.046364 1.917849
H -4.822669 3.955325 1.911345
H -6.142537 4.425416 0.800552
H 5.039128 2.271225 0.832452
H 1.460968 4.050750 -0.163358
H 2.133452 3.611196 -1.781779
H 2.935216 4.890685 -0.787434


